In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2009 | 31 | Yes |
Popular Name: 4-methoxy-N-[(1S)-2-methyl-1-[[6-(3-oxopiperazin-1-yl)-3-pyridyl]carbamoyl]propyl]benzamide 4-methoxy-N-[(1S)-2-methyl-1-[[6…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.94 | 2.67 | -18.92 | 3 | 9 | 0 | 113 | 425.489 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 3.12 | -53.23 | 4 | 9 | 1 | 114 | 426.497 | 7 | ↓ |